1-[(4-methylsulfanylphenyl)-naphthalen-2-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(4-methylsulfanylphenyl)-naphthalen-2-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-methylsulfanylphenyl)-(2-naphthyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[4-(methylthio)phenyl]-(2-naphthalenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(4-methylsulfanylphenyl)-naphthalen-2-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[[4-(methylthio)phenyl]-(2-naphthyl)methyl]proline Formula: C23H23NO2S MolecularWeight: 377.49922

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(C2=CC3=CC=CC=C3C=C2)N4CCCC4C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C(C2=CC3=CC=CC=C3C=C2)N4CCCC4C(=O)O

InChI

InChI=1S/C23H23NO2S/c1-27-20-12-10-17(11-13-20)22(24-14-4-7-21(24)23(25)26)19-9-8-16-5-2-3-6-18(16)15-19/h2-3,5-6,8-13,15,21-22H,4,7,14H2,1H3,(H,25,26)